About 3-methoxy-N-(3-phenylphenyl)benzamide
3-methoxy-N-(3-phenylphenyl)benzamide (PubChem CID 798645) has the molecular formula C20H17NO2
and a molecular weight of 303.36 g/mol. Its IUPAC name is 3-methoxy-N-(3-phenylphenyl)benzamide.
Molecular Properties
| Compound Name | 3-methoxy-N-(3-phenylphenyl)benzamide |
| PubChem CID | 798645 |
| Molecular Formula | C20H17NO2 |
| Molecular Weight | 303.36 g/mol |
| Exact Mass | 303.13 |
| IUPAC Name | 3-methoxy-N-(3-phenylphenyl)benzamide |
| SMILES | COc1cccc(C(=O)Nc2cccc(-c3ccccc3)c2)c1 |
| InChI | InChI=1S/C20H17NO2/c1-23-19-12-6-10-17(14-19)20(22)21-18-11-5-9-16(13-18)15-7-3-2-4-8-15/h2-14H,1H3,(H,21,22) |
| InChIKey | HBLACSKZCOAAMY-UHFFFAOYSA-N |
| XLogP | 4.61 |
| TPSA | 38.33 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Heavy Atoms | 23 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 303.36 |
| LogP ≤ 5 | 4.61 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 2 |
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Frequently Asked Questions
What is the IUPAC name of 3-methoxy-N-(3-phenylphenyl)benzamide?
The IUPAC name of 3-methoxy-N-(3-phenylphenyl)benzamide (CID 798645) is 3-methoxy-N-(3-phenylphenyl)benzamide.
What is the SMILES notation for 3-methoxy-N-(3-phenylphenyl)benzamide?
The canonical SMILES for 3-methoxy-N-(3-phenylphenyl)benzamide is COc1cccc(C(=O)Nc2cccc(-c3ccccc3)c2)c1.
What is the InChIKey of 3-methoxy-N-(3-phenylphenyl)benzamide?
The InChIKey is HBLACSKZCOAAMY-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H17NO2/c1-23-19-12-6-10-17(14-19)20(22)21-18-11-5-9-16(13-18)15-7-3-2-4-8-15/h2-14H,1H3,(H,21,22).
What are the key properties of 3-methoxy-N-(3-phenylphenyl)benzamide?
3-methoxy-N-(3-phenylphenyl)benzamide has a molecular weight of 303.36 g/mol, XLogP of 4.61, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methoxy-N-(3-phenylphenyl)benzamide is sourced from PubChem (CID 798645), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).